SOLUTION NMR

NMR Experiment
Experiment Type Sample Contents Ionic Strength Solvent pH Pressure Temprature (K)
1 NOESY 95% WATER/ 5% D2O ? ? 3.50 ? 293.00
2 DQF-COSY 95% WATER/ 5% D2O ? ? 3.50 ? 293.00
3 TOCSY 95% WATER/ 5% D2O ? ? 3.50 ? 293.00
4 E-COSY 95% WATER/ 5% D2O ? ? 3.50 ? 293.00
NMR Spectrometer Information
Spectrometer Manufacturer Model Field Strength
NMR Refinement
Method Details Software
MOLECULAR DYNAMICS/ SIMULATED ANNEALING REFINEMENT BASED ON CHARMM PARAMTERS, DETAILS IN JRNL CITATION ABOVE 1
NMR Ensemble Information
Conformer Selection Criteria LEAST RESTRAINT VIOLATION
Conformers Calculated Total Number 50
Conformers Submitted Total Number 17
Representative Model 1 (?)
Computation: NMR Software
# Classification Version Software Name Author
1 refinement 3.8 X-PLOR BRUNGER
2 structure solution ? X-PLOR ?
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